3-(2-methylphenyl)-6-oxidanyl-2-sulfanyl-1,3-diazinan-4-one

Systemtic Name: 3-(2-methylphenyl)-6-oxidanyl-2-sulfanyl-1,3-diazinan-4-one Openeye Name: 6-hydroxy-3-(o-tolyl)-2-sulfanyl-hexahydropyrimidin-4-one CAS Name: 6-hydroxy-2-mercapto-3-(2-methylphenyl)-1,3-diazinan-4-one IUPAC Name: 6-hydroxy-3-(2-methylphenyl)-2-sulfanyl-1,3-diazinan-4-one Traditional Name: 6-hydroxy-2-mercapto-3-(o-tolyl)hexahydropyrimidin-4-one Formula: C11H14N2O2S MolecularWeight: 238.30606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(NC(CC2=O)O)S

Isomeric SMILES

CC1=CC=CC=C1N2C(NC(CC2=O)O)S

InChI

InChI=1S/C11H14N2O2S/c1-7-4-2-3-5-8(7)13-10(15)6-9(14)12-11(13)16/h2-5,9,11-12,14,16H,6H2,1H3